5-[(2-ethyl-3H-benzimidazol-5-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 5-[(2-ethyl-3H-benzimidazol-5-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline Openeye Name: 5-[(2-ethyl-3H-benzimidazol-5-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline CAS Name: 5-[(2-ethyl-3H-benzimidazol-5-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 5-[(2-ethyl-3H-benzimidazol-5-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline Traditional Name: 5-[(2-ethyl-3H-benzimidazol-5-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1)C=C(C=C2)S(=O)(=O)C3=CC=CC4=C3CCNC4

Isomeric SMILES

CCC1=NC2=C(N1)C=C(C=C2)S(=O)(=O)C3=CC=CC4=C3CCNC4

InChI

InChI=1S/C18H19N3O2S/c1-2-18-20-15-7-6-13(10-16(15)21-18)24(22,23)17-5-3-4-12-11-19-9-8-14(12)17/h3-7,10,19H,2,8-9,11H2,1H3,(H,20,21)